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Reference substances

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IUPAC name:
Reaction mass of 7-methyloctyl hexadecanoate and 7-methyloctyl octadecanoate

Inventory

EC number:
292-960-4
EC name:
Fatty acids, C16-18, isononyl esters
CAS number:
91031-57-1
CAS number:
91031-57-1

Synonyms

Molecular and structural information

Molecular formula:
C25H50O2
C27H54O2
Molecular weight:
>= 382.66 - <= 410.72
SMILES notation:
CC(C)CCCCCCOC(=O)CCCCCCCCCCCCCCC
CC(C)CCCCCCOC(=O)CCCCCCCCCCCCCCCCC
InChl:
InChI=1S/C25H50O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(26)27-23-20-17-16-18-21-24(2)3/h24H,4-23H2,1-3H3
InChI=1S/C27H54O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-27(28)29-25-22-19-18-20-23-26(2)3/h26H,4-25H2,1-3H3
Structural formula:
Chemical structure

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